N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide

C19H20N2O5S — CID 1152899

IUPACN-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide
SMILESCC(=O)c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H20N2O5S/c1-14(22)15-2-6-17(7-3-15)20-19(23)16-4-8-18(9-5-16)27(24,25)21-10-12-26-13-11-21/h2-9H,10-13H2,1H3,(H,20,23)
InChIKeyJGOAHVBMGWNDEV-UHFFFAOYSA-N
MW388.45 g/mol
LogP2.16
Rot. Bonds5

About N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide

N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide (PubChem CID 1152899) has the molecular formula C19H20N2O5S and a molecular weight of 388.45 g/mol. Its IUPAC name is N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide
PubChem CID1152899
Molecular FormulaC19H20N2O5S
Molecular Weight388.45 g/mol
Exact Mass388.11
IUPAC NameN-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide
SMILESCC(=O)c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H20N2O5S/c1-14(22)15-2-6-17(7-3-15)20-19(23)16-4-8-18(9-5-16)27(24,25)21-10-12-26-13-11-21/h2-9H,10-13H2,1H3,(H,20,23)
InChIKeyJGOAHVBMGWNDEV-UHFFFAOYSA-N
XLogP2.16
TPSA92.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-acetylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 650028
4-iodo-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
CID 3955565
N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1157332
N-(4-acetylphenyl)-3-morpholin-4-ylsulfonylbenzamide
CID 1081959
[4-[(4-morpholin-4-ylsulfonylphenyl)carbamoyl]phenyl] acetate
CID 1164288
4-morpholin-4-ylsulfonyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 17391128
4-(acetamidomethyl)-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
CID 43030692
N-(4-acetylphenyl)-2-hydroxy-5-morpholin-4-ylsulfonylbenzamide
CID 43853441
N-(4-morpholin-4-ylsulfonylphenyl)furan-3-carboxamide
CID 17015677
4-morpholin-4-ylsulfonyl-N-(4-nitrophenyl)benzamide
CID 4282639
N-(3,5-dimethylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1077896
4-methyl-N-[4-[2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]ethylcarbamoyl]phenyl]benzamide
CID 121062034

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide (CID 1152899) is N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide is CC(=O)c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide?
The InChIKey is JGOAHVBMGWNDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5S/c1-14(22)15-2-6-17(7-3-15)20-19(23)16-4-8-18(9-5-16)27(24,25)21-10-12-26-13-11-21/h2-9H,10-13H2,1H3,(H,20,23).
What are the key properties of N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide?
N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide has a molecular weight of 388.45 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 1152899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).